(NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine

C21H21N3O2 — CID 56658631

IUPAC(NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine
SMILESO/N=C(/c1ccc(Oc2ccc3ccccc3c2)nc1)N1CCCCC1
InChIInChI=1S/C21H21N3O2/c25-23-21(24-12-4-1-5-13-24)18-9-11-20(22-15-18)26-19-10-8-16-6-2-3-7-17(16)14-19/h2-3,6-11,14-15,25H,1,4-5,12-13H2/b23-21-
InChIKeyGWXPPJUJTFEJHE-LNVKXUELSA-N
MW347.42 g/mol
LogP4.65
Rot. Bonds3

About (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine

(NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine (PubChem CID 56658631) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine
PubChem CID56658631
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name(NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine
SMILESO/N=C(/c1ccc(Oc2ccc3ccccc3c2)nc1)N1CCCCC1
InChIInChI=1S/C21H21N3O2/c25-23-21(24-12-4-1-5-13-24)18-9-11-20(22-15-18)26-19-10-8-16-6-2-3-7-17(16)14-19/h2-3,6-11,14-15,25H,1,4-5,12-13H2/b23-21-
InChIKeyGWXPPJUJTFEJHE-LNVKXUELSA-N
XLogP4.65
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine (CID 56658631) is (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine is O/N=C(/c1ccc(Oc2ccc3ccccc3c2)nc1)N1CCCCC1.
What is the InChIKey of (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine?
The InChIKey is GWXPPJUJTFEJHE-LNVKXUELSA-N. The full InChI is InChI=1S/C21H21N3O2/c25-23-21(24-12-4-1-5-13-24)18-9-11-20(22-15-18)26-19-10-8-16-6-2-3-7-17(16)14-19/h2-3,6-11,14-15,25H,1,4-5,12-13H2/b23-21-.
What are the key properties of (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine?
(NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine has a molecular weight of 347.42 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(6-naphthalen-2-yloxy-3-pyridinyl)-piperidin-1-ylmethylidene]hydroxylamine is sourced from PubChem (CID 56658631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).